N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-methyl-2-(pyrrolidin-1-yl)pyrimidine-5-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-methyl-2-(pyrrolidin-1-yl)pyrimidine-5-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-methyl-2-(pyrrolidin-1-yl)pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | G415-3025 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-methyl-2-(pyrrolidin-1-yl)pyrimidine-5-carboxamide |
| Molecular Weight: | 340.38 |
| Molecular Formula: | C18 H20 N4 O3 |
| Smiles: | Cc1c(cnc(n1)N1CCCC1)C(NCc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4859 |
| logD: | 2.4858 |
| logSw: | -2.9368 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.182 |
| InChI Key: | PBIABXKCOOACHF-UHFFFAOYSA-N |